4-(5-cyano-6-ethoxy-2-methylsulfanyl-pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanamide

Systemtic Name: 4-(5-cyano-6-ethoxy-2-methylsulfanyl-pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanamide Openeye Name: 4-(5-cyano-6-ethoxy-2-methylsulfanyl-pyrimidin-4-yl)sulfanyl-3-oxo-butanamide CAS Name: 4-[[5-cyano-6-ethoxy-2-(methylthio)-4-pyrimidinyl]thio]-3-oxobutanamide IUPAC Name: 4-(5-cyano-6-ethoxy-2-methylsulfanylpyrimidin-4-yl)sulfanyl-3-oxobutanamide Traditional Name: 4-[[5-cyano-6-ethoxy-2-(methylthio)pyrimidin-4-yl]thio]-3-keto-butyramide Formula: C12H14N4O3S2 MolecularWeight: 326.39456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NC(=N1)SC)SCC(=O)CC(=O)N)C#N

Isomeric SMILES

CCOC1=C(C(=NC(=N1)SC)SCC(=O)CC(=O)N)C#N

InChI

InChI=1S/C12H14N4O3S2/c1-3-19-10-8(5-13)11(16-12(15-10)20-2)21-6-7(17)4-9(14)18/h3-4,6H2,1-2H3,(H2,14,18)